SpectraBase Spectrum ID |
I0YUkWkia5 |
Name |
1-(1,2-Diphenylethyl)-3-(m-methoxyphenyl)-2-thiourea |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
362.145284509 u |
Formula |
C22H22N2OS |
InChI |
InChI=1S/C22H22N2OS/c1-25-20-14-8-13-19(16-20)23-22(26)24-21(18-11-6-3-7-12-18)15-17-9-4-2-5-10-17/h2-14,16,21H,15H2,1H3,(H2,23,24,26) |
InChIKey |
BXOKUIZEEVRUOA-UHFFFAOYSA-N |
Molecular Weight |
362.491 g/mol |
SMILES |
N(C1=CC=CC(=C1)OC)C(NC(CC=1C=CC=CC1)C=1C=CC=CC1)=S |
Spectrum/Structure Validation Score (Raman) |
0.993497 |